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Nonuniqueness in the close-coupling method for e-He scattering

Authors :
Lindsay Berge
Andris T. Stelbovics
Source :
Physical Review A. 55:1028-1038
Publication Year :
1997
Publisher :
American Physical Society (APS), 1997.

Abstract

We present a general analysis of the close-coupling equations for e-He scattering. We show why the standard close-coupling expansion gives rise to nonunique solutions and, by characterizing the manifold of nonunique solutions, are able to construct equations with a unique solution. Our analysis concentrates on two models of target states; a frozen-core model in which one of the electrons is restricted to the 1s He+ orbital, as has been used with great success recently, and also a model which uses full configuration-interaction target states. We develop modified close-coupling equations by projecting out spurious solutions. A subtle difference between frozen-core and configuration-interaction models with respect to the manner in which antisymmetrization is incorporated is noted. A calculation to illustrate the theory is presented.

Details

ISSN :
10941622 and 10502947
Volume :
55
Database :
OpenAIRE
Journal :
Physical Review A
Accession number :
edsair.doi...........05581ab297cde27fc5996929deeaf335
Full Text :
https://doi.org/10.1103/physreva.55.1028